#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ban s ILE 4 N 0.00 4.81 0.00 1.34 1.01 -1.26 -4.84 121.20 122.27 1ban s ILE 4 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.78 1ban s ILE 4 Cb 0.00 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.25 1ban s ILE 4 CO 0.00 -0.61 0.79 -0.46 0.00 0.00 0.00 174.94 174.66 1ban n ASN 5 N 6.30 0.00 -4.92 3.58 6.94 -1.26 -4.82 115.26 121.07 1ban n ASN 5 Ca -0.01 -1.62 -0.30 0.00 -0.02 0.00 0.00 54.58 52.63 1ban n ASN 5 Cb 0.48 -0.12 -0.04 0.00 -2.36 0.00 0.00 39.78 37.74 1ban n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1ban s THR 6 N 0.00 5.37 0.16 5.53 -4.23 -1.26 -0.98 115.64 120.23 1ban s THR 6 Ca 0.00 -0.44 -0.17 0.00 -1.18 0.00 0.00 61.69 59.89 1ban s THR 6 Cb 0.00 -3.66 0.08 0.00 1.34 0.00 0.00 72.50 70.27 1ban s THR 6 CO 0.00 0.08 1.67 -0.26 -0.54 0.00 0.00 174.62 175.57 1ban h PHE 7 N 2.85 -0.22 -0.17 3.99 0.04 -1.98 -0.98 116.94 120.47 1ban h PHE 7 Ca -0.46 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.19 1ban h PHE 7 Cb 1.17 0.16 -0.01 0.00 2.20 0.00 0.00 35.95 39.47 1ban h PHE 7 CO 0.59 -0.17 -0.54 -0.44 -0.60 0.00 0.00 178.31 177.15 1ban h ASP 8 N -0.01 0.54 0.27 2.17 3.32 -1.99 -2.73 116.42 117.99 1ban h ASP 8 Ca 0.18 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1ban h ASP 8 Cb 0.29 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1ban h ASP 8 CO -0.39 0.97 -0.15 1.23 -1.72 0.00 0.00 179.24 179.18 1ban h GLY 9 N 1.14 -0.40 1.00 2.75 0.00 -1.80 0.12 103.07 105.87 1ban h GLY 9 Ca 0.01 0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 1ban h GLY 9 CO 0.10 -0.15 0.37 -2.08 0.00 0.00 0.00 176.54 174.77 1ban h VAL 10 N -0.39 1.18 -0.14 4.60 2.07 -1.21 -0.94 116.25 121.43 1ban h VAL 10 Ca -0.03 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1ban h VAL 10 Cb 0.31 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1ban h VAL 10 CO 0.05 0.19 -0.01 0.00 0.02 0.00 0.00 177.57 177.82 1ban h ALA 11 N 1.18 0.19 -0.42 1.67 0.00 -1.48 0.16 119.26 120.57 1ban h ALA 11 Ca 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1ban h ALA 11 Cb -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1ban h ALA 11 CO -0.04 -0.10 0.12 -0.44 0.00 0.00 0.00 179.25 178.79 1ban h ASP 12 N -0.02 0.62 -0.30 0.00 3.32 -0.86 -2.62 116.42 116.56 1ban h ASP 12 Ca 0.04 -0.21 0.05 0.00 0.02 0.00 0.00 57.03 56.92 1ban h ASP 12 Cb 0.39 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.70 1ban h ASP 12 CO 0.01 0.67 -0.52 0.22 -1.72 0.00 0.00 179.24 177.90 1ban h TYR 13 N 0.54 -1.55 -0.58 4.55 3.20 -0.85 -0.57 116.97 121.70 1ban h TYR 13 Ca 0.13 0.07 0.12 0.00 3.14 0.00 0.00 58.73 62.19 1ban h TYR 13 Cb 0.28 0.72 -0.10 0.00 1.54 0.00 0.00 36.73 39.17 1ban h TYR 13 CO 0.01 -0.50 -0.02 -0.07 -1.64 0.00 0.00 178.16 175.95 1ban h LEU 14 N -0.45 -0.29 -0.64 2.82 3.38 -0.57 0.43 115.31 119.98 1ban h LEU 14 Ca 0.07 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 1ban h LEU 14 Cb 0.63 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1ban h LEU 14 CO -0.53 -0.11 0.03 1.56 0.09 0.00 0.00 178.44 179.48 1ban h GLN 15 N 0.10 1.09 0.07 1.13 4.20 -1.25 1.37 115.11 121.82 1ban h GLN 15 Ca 0.30 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1ban h GLN 15 Cb 0.47 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1ban h GLN 15 CO -0.51 1.04 -0.03 1.15 -0.67 0.00 0.00 178.83 179.81 1ban h THR 16 N 1.00 1.21 0.00 -0.54 2.02 -0.20 -3.39 112.91 113.00 1ban h THR 16 Ca 0.18 -1.45 0.00 0.00 0.77 0.00 0.00 66.41 65.92 1ban h THR 16 Cb 0.53 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 69.02 1ban h THR 16 CO 0.03 0.33 -1.02 -1.22 0.37 0.00 0.00 175.52 174.01 1ban n TYR 17 N -4.82 0.13 -2.02 3.16 4.01 0.14 -4.97 117.16 112.79 1ban n TYR 17 Ca -0.08 0.04 -0.20 0.00 -0.16 0.00 0.00 57.90 57.50 1ban n TYR 17 Cb 0.30 -0.29 -0.04 0.00 -0.31 0.00 0.00 39.34 39.00 1ban n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1ban n HIS 18 N -1.79 -0.53 -3.47 -0.72 8.25 0.47 -4.92 115.22 112.51 1ban n HIS 18 Ca 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.38 1ban n HIS 18 Cb 0.40 -3.59 -0.02 0.00 1.12 0.00 0.00 29.99 27.90 1ban n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1ban s LYS 19 N -4.41 1.10 0.45 -0.41 0.00 -1.26 -5.06 119.74 110.15 1ban s LYS 19 Ca 0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 55.97 55.35 1ban s LYS 19 Cb 0.00 0.50 -0.10 0.00 0.00 0.00 0.00 37.83 38.23 1ban s LYS 19 CO 0.00 -0.48 1.00 -0.51 0.00 0.00 0.00 175.35 175.36 1ban s LEU 20 N -2.64 3.92 1.10 2.77 1.43 -1.26 -3.93 118.68 120.06 1ban s LEU 20 Ca 0.03 1.84 -0.12 0.00 -1.03 0.00 0.00 54.13 54.85 1ban s LEU 20 Cb -0.01 -4.51 0.25 0.00 0.03 0.00 0.00 46.19 41.95 1ban s LEU 20 CO -0.11 -0.58 1.06 -2.84 0.23 0.00 0.00 176.35 174.11 1ban s PRO 21 N -3.12 -0.40 0.01 1.29 0.02 -1.26 -4.93 135.00 126.62 1ban s PRO 21 Ca 0.64 0.94 0.21 0.00 0.02 0.00 0.00 61.00 62.81 1ban s PRO 21 Cb -0.14 -1.61 0.89 0.00 0.02 0.00 0.00 34.50 33.67 1ban s PRO 21 CO 0.18 -3.40 1.67 -0.40 -0.33 0.00 0.00 177.00 174.72 1ban n ASP 22 N -4.70 0.03 0.00 2.53 3.85 -1.26 -2.63 116.55 114.37 1ban n ASP 22 Ca 0.05 0.51 0.10 0.00 -0.71 0.00 0.00 54.79 54.74 1ban n ASP 22 Cb 0.54 -0.51 0.61 0.00 -1.35 0.00 0.00 41.12 40.41 1ban n ASP 22 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1ban n ASN 23 N -1.53 0.00 -4.78 -1.12 6.94 -1.26 -4.81 115.26 108.69 1ban n ASN 23 Ca 0.05 -0.90 -0.36 0.00 -0.02 0.00 0.00 54.58 53.35 1ban n ASN 23 Cb 0.25 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.60 1ban n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1ban s TYR 24 N -2.00 3.50 -0.01 -2.53 2.02 -1.08 -0.45 117.35 116.80 1ban s TYR 24 Ca 0.31 0.47 -0.03 0.00 -0.37 0.00 0.00 57.07 57.45 1ban s TYR 24 Cb 0.14 -2.12 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1ban s TYR 24 CO 0.24 0.44 0.07 0.96 -1.57 0.00 0.00 175.55 175.69 1ban s ILE 25 N -0.14 0.04 0.72 2.71 -4.36 -0.98 -4.90 121.20 114.28 1ban s ILE 25 Ca 0.12 -0.31 -0.11 0.00 -0.26 0.00 0.00 60.65 60.09 1ban s ILE 25 Cb -0.12 -0.20 0.03 0.00 1.25 0.00 0.00 42.46 43.42 1ban s ILE 25 CO 0.02 -0.17 1.09 0.42 0.24 0.00 0.00 174.94 176.54 1ban s THR 26 N -0.53 3.11 0.29 8.37 -4.23 -1.23 -1.18 115.64 120.26 1ban s THR 26 Ca -0.06 0.29 0.04 0.00 -1.18 0.00 0.00 61.69 60.78 1ban s THR 26 Cb -0.04 -3.35 0.29 0.00 1.34 0.00 0.00 72.50 70.74 1ban s THR 26 CO 0.00 -0.44 1.74 0.11 -0.54 0.00 0.00 174.62 175.49 1ban h LYS 27 N -0.69 0.59 0.25 3.99 1.57 -1.96 0.10 116.57 120.42 1ban h LYS 27 Ca -0.45 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 1ban h LYS 27 Cb 1.27 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 1ban h LYS 27 CO 0.64 0.39 -0.13 0.77 -0.57 0.00 0.00 179.45 180.54 1ban h SER 28 N 0.60 -0.33 -0.40 0.86 0.02 -1.98 -0.41 113.55 111.91 1ban h SER 28 Ca 0.56 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.59 1ban h SER 28 Cb 0.95 0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.53 1ban h SER 28 CO -0.43 -0.22 0.07 -0.33 -1.14 0.00 0.00 176.83 174.77 1ban h GLU 29 N -0.36 0.19 0.31 3.45 5.08 -1.83 -0.17 114.58 121.24 1ban h GLU 29 Ca -0.03 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1ban h GLU 29 Cb 0.29 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1ban h GLU 29 CO 0.04 0.12 -0.15 0.00 -1.00 0.00 0.00 179.01 178.03 1ban h ALA 30 N 1.31 -0.41 -0.48 3.43 0.00 -0.47 -2.81 119.26 119.82 1ban h ALA 30 Ca 0.19 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1ban h ALA 30 Cb 0.24 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1ban h ALA 30 CO -0.26 -0.72 0.24 1.96 0.00 0.00 0.00 179.25 180.46 1ban h GLN 31 N -0.43 0.46 -0.49 0.00 4.20 -0.94 -1.56 115.11 116.35 1ban h GLN 31 Ca -0.04 -0.03 0.13 0.00 0.06 0.00 0.00 58.65 58.77 1ban h GLN 31 Cb 0.33 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1ban h GLN 31 CO 0.07 0.30 0.35 0.00 -0.67 0.00 0.00 178.83 178.88 1ban h ALA 32 N 1.26 2.40 0.00 3.87 0.00 -0.84 0.12 119.26 126.07 1ban h ALA 32 Ca 0.21 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1ban h ALA 32 Cb 0.12 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ban h ALA 32 CO -0.15 -0.53 -0.02 -0.07 0.00 0.00 0.00 179.25 178.47 1ban h LEU 33 N 0.05 0.00 0.00 0.00 3.38 -1.06 -3.47 115.31 114.21 1ban h LEU 33 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1ban h LEU 33 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1ban h LEU 33 CO -0.01 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1ban n GLY 34 N 0.89 1.58 3.72 0.83 0.00 0.42 -5.01 105.19 107.62 1ban n GLY 34 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1ban n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1ban s TRP 35 N -2.00 3.37 -0.35 1.61 -0.00 -0.80 -4.98 118.94 115.80 1ban s TRP 35 Ca 0.00 1.22 0.04 0.00 -0.00 0.00 0.00 56.10 57.36 1ban s TRP 35 Cb 0.00 -3.51 0.10 0.00 -0.00 0.00 0.00 33.47 30.06 1ban s TRP 35 CO 0.00 -1.61 0.06 0.08 -0.00 0.00 0.00 176.95 175.48 1ban s VAL 36 N 0.77 2.30 0.28 5.86 1.01 -1.26 -4.34 120.40 125.02 1ban s VAL 36 Ca 0.59 -2.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.15 1ban s VAL 36 Cb -0.33 -2.70 0.34 0.00 0.00 0.00 0.00 36.38 33.70 1ban s VAL 36 CO 0.32 -0.61 1.61 0.00 0.00 0.00 0.00 175.10 176.41 1ban h ALA 37 N 7.56 0.99 0.00 5.51 0.00 -1.98 -2.28 119.26 129.05 1ban h ALA 37 Ca -0.04 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ban h ALA 37 Cb 1.01 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1ban h ALA 37 CO 0.53 -0.48 0.00 0.43 0.00 0.00 0.00 179.25 179.73 1ban n SER 38 N -5.40 0.00 -0.03 0.00 7.64 -1.26 -2.74 113.62 111.83 1ban n SER 38 Ca 0.18 0.49 0.03 0.00 1.01 0.00 0.00 58.87 60.58 1ban n SER 38 Cb 0.61 -0.49 -0.13 0.00 -1.01 0.00 0.00 64.21 63.18 1ban n SER 38 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1ban n LYS 39 N -1.49 0.83 -2.62 1.43 4.81 -0.87 -5.01 118.16 115.23 1ban n LYS 39 Ca 0.04 -0.11 -0.14 0.00 -0.87 0.00 0.00 58.31 57.24 1ban n LYS 39 Cb 0.20 -1.42 0.02 0.00 0.02 0.00 0.00 35.03 33.85 1ban n LYS 39 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ban n GLY 40 N 1.68 -0.08 1.80 3.14 0.00 -1.11 -4.92 105.19 105.70 1ban n GLY 40 Ca -0.12 -0.25 0.06 0.00 0.00 0.00 0.00 46.02 45.72 1ban n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ban n ASN 41 N -0.79 5.51 -0.36 1.61 6.94 -1.25 -3.84 115.26 123.08 1ban n ASN 41 Ca -0.09 -2.97 0.04 0.00 -0.02 0.00 0.00 54.58 51.55 1ban n ASN 41 Cb 0.58 -0.68 0.20 0.00 -2.36 0.00 0.00 39.78 37.53 1ban n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1ban h LEU 42 N 3.69 0.99 -0.61 -4.53 5.85 -1.88 -0.79 115.31 118.03 1ban h LEU 42 Ca 0.02 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 1ban h LEU 42 Cb 1.96 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.79 1ban h LEU 42 CO 0.48 0.60 -0.41 0.00 -0.34 0.00 0.00 178.44 178.77 1ban h ALA 43 N 1.49 0.87 -0.03 1.25 0.00 -1.82 0.25 119.26 121.27 1ban h ALA 43 Ca 0.46 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ban h ALA 43 Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ban h ALA 43 CO -0.20 0.51 -0.17 -0.44 0.00 0.00 0.00 179.25 178.95 1ban h ASP 44 N 0.00 0.21 0.01 0.00 3.32 -1.53 -3.17 116.42 115.26 1ban h ASP 44 Ca -0.00 -0.66 -0.06 0.00 0.02 0.00 0.00 57.03 56.33 1ban h ASP 44 Cb 1.07 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1ban h ASP 44 CO 0.05 0.84 -0.22 -0.37 -1.72 0.00 0.00 179.24 177.82 1ban h VAL 45 N -0.40 1.58 -2.55 -1.35 -1.51 -1.22 -3.40 116.25 107.40 1ban h VAL 45 Ca -0.01 -2.00 -0.60 0.00 -1.23 0.00 0.00 66.70 62.86 1ban h VAL 45 Cb 0.84 2.86 -0.40 0.00 -2.13 0.00 0.00 31.29 32.46 1ban h VAL 45 CO 0.04 0.54 -0.82 0.00 -1.23 0.00 0.00 177.57 176.10 1ban n ALA 46 N -2.54 3.11 -1.67 5.19 0.00 0.88 -5.06 120.51 120.42 1ban n ALA 46 Ca -0.10 -3.78 -0.56 0.00 0.00 0.00 0.00 53.44 49.00 1ban n ALA 46 Cb 0.50 -0.87 -0.07 0.00 0.00 0.00 0.00 19.45 19.01 1ban n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ban n PRO 47 N 2.19 1.06 -0.64 0.00 -0.02 -1.20 -1.17 135.00 135.23 1ban n PRO 47 Ca 0.26 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1ban n PRO 47 Cb 0.43 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1ban n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ban n GLY 48 N 3.57 0.95 3.94 -1.23 0.00 -1.26 -5.04 105.19 106.11 1ban n GLY 48 Ca 0.24 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 1ban n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ban s LYS 49 N -0.30 3.31 0.04 1.61 -0.14 -0.31 -4.77 119.74 119.17 1ban s LYS 49 Ca 0.00 -0.84 0.03 0.00 -1.36 0.00 0.00 55.97 53.80 1ban s LYS 49 Cb 0.00 -2.81 -0.02 0.00 -1.68 0.00 0.00 37.83 33.32 1ban s LYS 49 CO 0.00 0.41 -0.10 -1.12 -0.76 0.00 0.00 175.35 173.77 1ban s SER 50 N -3.95 1.21 0.12 2.83 0.01 0.41 -4.84 113.70 109.49 1ban s SER 50 Ca 0.34 -0.47 -0.30 0.00 1.31 0.00 0.00 55.95 56.83 1ban s SER 50 Cb -0.09 -0.04 -0.07 0.00 0.21 0.00 0.00 66.02 66.04 1ban s SER 50 CO 0.28 -0.07 1.23 -0.63 0.41 0.00 0.00 173.24 174.46 1ban s ILE 51 N -1.03 3.72 -0.23 1.44 -1.09 -1.26 -2.32 121.20 120.43 1ban s ILE 51 Ca -0.03 1.32 -0.29 0.00 -2.23 0.00 0.00 60.65 59.41 1ban s ILE 51 Cb -0.08 -3.84 0.16 0.00 -1.58 0.00 0.00 42.46 37.11 1ban s ILE 51 CO 0.01 0.15 1.19 -0.83 -1.23 0.00 0.00 174.94 174.22 1ban s GLY 52 N 0.67 -0.07 0.00 6.18 0.00 -0.32 -1.04 107.32 112.74 1ban s GLY 52 Ca 0.57 2.49 0.00 0.00 0.00 0.00 0.00 44.72 47.78 1ban s GLY 52 CO 0.33 1.13 0.00 0.61 0.00 0.00 0.00 173.10 175.17 1ban n GLY 53 N 0.72 2.67 3.76 0.20 0.00 -0.33 -3.47 105.19 108.74 1ban n GLY 53 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1ban n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ban s ASP 54 N -1.59 6.65 0.35 1.61 1.01 -1.25 -4.76 116.67 118.70 1ban s ASP 54 Ca 0.00 2.74 -0.27 0.00 0.71 0.00 0.00 52.55 55.73 1ban s ASP 54 Cb 0.00 -2.64 -0.09 0.00 1.01 0.00 0.00 42.92 41.19 1ban s ASP 54 CO 0.00 -0.65 1.22 -0.63 0.21 0.00 0.00 175.17 175.32 1ban s ILE 55 N -0.71 3.00 -0.23 0.77 1.01 -1.26 -1.65 121.20 122.13 1ban s ILE 55 Ca 0.53 0.93 -0.11 0.00 0.00 0.00 0.00 60.65 62.00 1ban s ILE 55 Cb -0.42 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 1ban s ILE 55 CO 0.51 0.17 0.19 0.12 0.00 0.00 0.00 174.94 175.93 1ban s PHE 56 N -1.25 3.34 0.11 3.97 5.36 0.19 -4.86 117.98 124.83 1ban s PHE 56 Ca 0.52 0.30 0.04 0.00 -0.96 0.00 0.00 56.93 56.82 1ban s PHE 56 Cb -0.35 -2.29 -0.23 0.00 -0.34 0.00 0.00 43.02 39.82 1ban s PHE 56 CO 0.45 0.09 1.24 0.66 -1.46 0.00 0.00 175.22 176.21 1ban h SER 57 N 7.35 0.12 -3.45 6.13 4.64 -1.96 -3.39 113.55 123.00 1ban h SER 57 Ca -0.38 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 60.76 1ban h SER 57 Cb 1.17 -0.04 0.03 0.00 -0.31 0.00 0.00 62.40 63.25 1ban h SER 57 CO 0.68 1.10 -0.15 -3.20 -0.87 0.00 0.00 176.83 174.39 1ban n ASN 58 N -3.41 -2.87 0.09 4.97 5.15 -1.26 -4.99 115.26 112.95 1ban n ASN 58 Ca -0.02 -0.12 -0.04 0.00 -0.60 0.00 0.00 54.58 53.79 1ban n ASN 58 Cb 0.96 -1.39 -0.02 0.00 -0.53 0.00 0.00 39.78 38.80 1ban n ASN 58 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 1ban h ARG 59 N -0.18 -0.28 0.00 1.20 -0.00 -2.01 -3.26 114.38 109.84 1ban h ARG 59 Ca -0.11 0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.89 1ban h ARG 59 Cb 1.05 0.06 0.00 0.00 -0.00 0.00 0.00 29.97 31.09 1ban h ARG 59 CO 0.08 -0.19 0.06 -0.85 -0.00 0.00 0.00 179.97 179.08 1ban n GLU 60 N -3.89 0.00 -0.84 0.08 0.28 -1.26 -4.81 120.64 110.21 1ban n GLU 60 Ca -0.04 0.31 0.00 0.00 -0.16 0.00 0.00 57.16 57.27 1ban n GLU 60 Cb 0.11 -1.56 0.00 0.00 1.43 0.00 0.00 31.44 31.42 1ban n GLU 60 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ban n GLY 61 N -1.29 0.51 0.50 -1.84 0.00 -1.23 -4.92 105.19 96.92 1ban n GLY 61 Ca 0.00 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.28 1ban n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ban h LYS 62 N 1.46 0.00 -6.25 1.61 6.56 -1.88 -3.42 116.57 114.65 1ban h LYS 62 Ca 0.00 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 59.02 1ban h LYS 62 Cb 0.10 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 31.67 1ban h LYS 62 CO 0.00 0.00 -0.60 -0.51 -2.06 0.00 0.00 179.45 176.28 1ban s LEU 63 N -6.64 3.56 -0.27 2.94 1.43 -1.26 -4.92 118.68 113.51 1ban s LEU 63 Ca -0.03 -0.30 -0.28 0.00 -1.03 0.00 0.00 54.13 52.48 1ban s LEU 63 Cb 0.14 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1ban s LEU 63 CO 0.48 0.05 1.94 -2.16 0.23 0.00 0.00 176.35 176.89 1ban s PRO 64 N -3.22 3.33 -1.17 1.29 0.04 -1.26 -4.96 135.00 129.05 1ban s PRO 64 Ca 0.30 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 63.00 1ban s PRO 64 Cb -0.09 -4.25 0.24 0.00 0.04 0.00 0.00 34.50 30.44 1ban s PRO 64 CO 0.21 -1.87 1.85 0.41 0.04 0.00 0.00 177.00 177.65 1ban n GLY 65 N 5.46 5.31 3.77 0.56 0.00 -1.26 -5.05 105.19 113.97 1ban n GLY 65 Ca 0.25 -2.37 -0.39 0.00 0.00 0.00 0.00 46.02 43.51 1ban n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ban s LYS 66 N -2.00 4.64 0.68 1.61 2.20 -1.26 -5.02 119.74 120.59 1ban s LYS 66 Ca 0.40 1.29 -0.17 0.00 -0.36 0.00 0.00 55.97 57.12 1ban s LYS 66 Cb 0.12 -3.12 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 1ban s LYS 66 CO -0.01 0.47 1.19 -1.13 -0.36 0.00 0.00 175.35 175.51 1ban n SER 67 N 1.22 1.54 -1.98 1.43 3.41 -1.26 -2.57 113.62 115.41 1ban n SER 67 Ca -0.02 0.77 -0.11 0.00 -0.26 0.00 0.00 58.87 59.24 1ban n SER 67 Cb 0.49 -1.51 0.04 0.00 -0.26 0.00 0.00 64.21 62.97 1ban n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ban n GLY 68 N 0.94 0.23 3.16 5.00 0.00 -1.26 -5.00 105.19 108.26 1ban n GLY 68 Ca 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 46.02 45.91 1ban n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ban s ARG 69 N -5.55 0.47 0.00 1.61 3.52 -1.06 -4.68 118.95 113.25 1ban s ARG 69 Ca 0.26 0.92 0.06 0.00 -0.13 0.00 0.00 55.73 56.84 1ban s ARG 69 Cb -0.11 0.24 -0.03 0.00 -1.56 0.00 0.00 34.95 33.49 1ban s ARG 69 CO 0.35 -0.52 -0.17 -0.08 -0.81 0.00 0.00 175.30 174.06 1ban s THR 70 N 2.73 2.82 -0.11 4.11 -1.32 -1.26 -4.80 115.64 117.81 1ban s THR 70 Ca 0.11 -1.02 -0.03 0.00 -1.21 0.00 0.00 61.69 59.55 1ban s THR 70 Cb -0.14 -2.14 -0.03 0.00 -1.51 0.00 0.00 72.50 68.67 1ban s THR 70 CO -0.18 0.45 -0.01 0.26 -2.21 0.00 0.00 174.62 172.93 1ban s TRP 71 N -0.83 3.12 0.21 9.09 0.52 -1.26 -1.77 118.94 128.02 1ban s TRP 71 Ca 0.13 0.06 0.11 0.00 0.02 0.00 0.00 56.10 56.42 1ban s TRP 71 Cb -0.10 -1.85 -0.05 0.00 -1.15 0.00 0.00 33.47 30.32 1ban s TRP 71 CO 0.03 0.31 -0.23 1.03 0.02 0.00 0.00 176.95 178.12 1ban s ARG 72 N -0.46 1.53 0.16 4.98 0.52 0.13 0.56 118.95 126.37 1ban s ARG 72 Ca 0.08 -1.57 0.07 0.00 -0.52 0.00 0.00 55.73 53.79 1ban s ARG 72 Cb -0.12 -1.79 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 1ban s ARG 72 CO 0.02 0.37 -0.14 -1.83 0.02 0.00 0.00 175.30 173.74 1ban s GLU 73 N -2.86 1.18 -0.09 3.54 -1.05 -0.66 -1.75 118.70 117.01 1ban s GLU 73 Ca 0.22 -1.43 -0.08 0.00 -0.15 0.00 0.00 54.97 53.53 1ban s GLU 73 Cb -0.07 -1.00 0.02 0.00 -0.44 0.00 0.00 34.13 32.65 1ban s GLU 73 CO 0.11 0.18 0.24 0.00 0.95 0.00 0.00 175.26 176.74 1ban s ALA 74 N -2.63 -0.60 0.24 -0.84 0.00 -0.77 -1.19 121.76 115.97 1ban s ALA 74 Ca 0.16 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 1ban s ALA 74 Cb -0.02 -0.41 -0.09 0.00 0.00 0.00 0.00 23.12 22.60 1ban s ALA 74 CO 0.04 -0.12 1.13 -0.51 0.00 0.00 0.00 175.76 176.31 1ban s ASP 75 N 0.19 7.21 0.15 0.00 1.11 -0.20 -2.08 116.67 123.05 1ban s ASP 75 Ca -0.01 2.24 0.11 0.00 0.18 0.00 0.00 52.55 55.08 1ban s ASP 75 Cb -0.02 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 1ban s ASP 75 CO -0.00 -0.23 -0.25 -0.63 1.18 0.00 0.00 175.17 175.24 1ban s ILE 76 N -0.72 2.34 -1.11 0.77 -1.09 0.15 -4.71 121.20 116.83 1ban s ILE 76 Ca 0.48 -1.85 0.00 0.00 -2.23 0.00 0.00 60.65 57.04 1ban s ILE 76 Cb -0.32 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1ban s ILE 76 CO 0.39 0.01 0.00 0.59 -1.23 0.00 0.00 174.94 174.70 1ban n ASN 77 N 0.64 -5.25 -4.71 3.58 3.02 -0.15 -4.46 115.26 107.92 1ban n ASN 77 Ca -0.16 0.26 -0.39 0.00 -0.03 0.00 0.00 54.58 54.26 1ban n ASN 77 Cb 0.54 -3.67 -0.05 0.00 -0.61 0.00 0.00 39.78 35.99 1ban n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ban s TYR 78 N -2.06 3.55 0.00 3.10 6.14 -1.26 -4.91 117.35 121.92 1ban s TYR 78 Ca 0.00 1.16 0.00 0.00 0.64 0.00 0.00 57.07 58.87 1ban s TYR 78 Cb 0.00 -2.76 0.00 0.00 0.42 0.00 0.00 41.96 39.62 1ban s TYR 78 CO 0.00 0.09 0.00 0.25 0.64 0.00 0.00 175.55 176.53 1ban n THR 79 N 3.81 0.00 -3.78 4.34 -2.24 -1.26 -4.92 114.28 110.22 1ban n THR 79 Ca -0.02 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.72 1ban n THR 79 Cb 0.51 -0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.30 1ban n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ban s SER 80 N -3.34 -0.14 0.00 3.42 1.04 -1.26 -4.77 113.70 108.65 1ban s SER 80 Ca 0.00 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.95 1ban s SER 80 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1ban s SER 80 CO 0.00 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.87 1ban n GLY 81 N -0.51 -1.69 3.63 7.32 0.00 -1.25 -4.88 105.19 107.81 1ban n GLY 81 Ca -0.06 -1.41 -0.39 0.00 0.00 0.00 0.00 46.02 44.17 1ban n GLY 81 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ban n PHE 82 N 0.00 1.11 -2.23 1.61 3.72 -1.26 -4.67 117.46 115.74 1ban n PHE 82 Ca 0.00 0.47 -0.38 0.00 -0.05 0.00 0.00 57.45 57.49 1ban n PHE 82 Cb 0.00 -2.20 -0.01 0.00 -0.94 0.00 0.00 39.48 36.33 1ban n PHE 82 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1ban s ARG 83 N -2.53 3.87 0.00 -1.08 0.52 -1.26 -5.03 118.95 113.44 1ban s ARG 83 Ca 0.71 1.86 0.00 0.00 -0.52 0.00 0.00 55.73 57.78 1ban s ARG 83 Cb -0.46 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.47 1ban s ARG 83 CO 0.51 -0.48 0.00 0.27 0.02 0.00 0.00 175.30 175.62 1ban n ASN 84 N -0.22 0.00 -0.60 0.23 6.94 -1.26 -5.06 115.26 115.29 1ban n ASN 84 Ca 0.06 -0.14 0.12 0.00 -0.02 0.00 0.00 54.58 54.60 1ban n ASN 84 Cb 0.47 0.00 0.19 0.00 -2.36 0.00 0.00 39.78 38.08 1ban n ASN 84 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1ban n SER 85 N -0.43 2.08 -4.65 0.53 7.64 -1.26 -4.93 113.62 112.60 1ban n SER 85 Ca 0.00 -1.57 -0.39 0.00 1.01 0.00 0.00 58.87 57.92 1ban n SER 85 Cb 0.00 0.17 -0.08 0.00 -1.01 0.00 0.00 64.21 63.30 1ban n SER 85 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1ban s ASP 86 N -2.24 6.43 -0.09 6.43 1.01 -1.26 -1.40 116.67 125.56 1ban s ASP 86 Ca 0.26 0.52 -0.12 0.00 0.71 0.00 0.00 52.55 53.92 1ban s ASP 86 Cb 0.19 -2.25 0.03 0.00 1.01 0.00 0.00 42.92 41.90 1ban s ASP 86 CO 0.43 -0.17 0.31 -0.13 0.21 0.00 0.00 175.17 175.83 1ban s ARG 87 N 1.73 0.46 -0.14 8.23 1.81 0.84 0.30 118.95 132.18 1ban s ARG 87 Ca 0.20 0.23 -0.08 0.00 -1.72 0.00 0.00 55.73 54.36 1ban s ARG 87 Cb -0.15 0.22 -0.04 0.00 -0.45 0.00 0.00 34.95 34.52 1ban s ARG 87 CO 0.09 -0.09 0.13 -1.50 -0.68 0.00 0.00 175.30 173.25 1ban s ILE 88 N -0.32 5.41 -0.25 1.52 2.07 -0.88 0.83 121.20 129.58 1ban s ILE 88 Ca -0.04 0.18 0.02 0.00 -1.41 0.00 0.00 60.65 59.39 1ban s ILE 88 Cb -0.03 -3.39 0.05 0.00 0.13 0.00 0.00 42.46 39.22 1ban s ILE 88 CO 0.02 0.56 -0.11 -0.76 -1.91 0.00 0.00 174.94 172.74 1ban s LEU 89 N -0.56 3.29 -0.00 8.50 2.01 -0.14 -1.85 118.68 129.93 1ban s LEU 89 Ca 0.12 -1.25 0.07 0.00 0.01 0.00 0.00 54.13 53.08 1ban s LEU 89 Cb -0.12 -1.56 -0.02 0.00 0.01 0.00 0.00 46.19 44.50 1ban s LEU 89 CO 0.02 -0.17 -0.21 -0.72 1.01 0.00 0.00 176.35 176.28 1ban s TYR 90 N 1.15 1.90 0.26 0.29 1.13 -0.72 -0.96 117.35 120.41 1ban s TYR 90 Ca -0.06 -0.36 0.08 0.00 -1.41 0.00 0.00 57.07 55.31 1ban s TYR 90 Cb -0.19 -1.20 -0.04 0.00 -1.10 0.00 0.00 41.96 39.44 1ban s TYR 90 CO -0.06 -0.00 0.15 0.00 -2.51 0.00 0.00 175.55 173.13 1ban s ALA 91 N -0.57 3.49 0.43 9.51 0.00 -0.93 0.18 121.76 133.89 1ban s ALA 91 Ca 0.08 -1.48 0.09 0.00 0.00 0.00 0.00 51.96 50.65 1ban s ALA 91 Cb -0.08 -1.17 0.95 0.00 0.00 0.00 0.00 23.12 22.82 1ban s ALA 91 CO -0.00 0.25 2.07 0.66 0.00 0.00 0.00 175.76 178.74 1ban h SER 92 N 1.58 0.35 0.50 0.00 4.64 -1.68 0.53 113.55 119.47 1ban h SER 92 Ca -0.47 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1ban h SER 92 Cb 1.24 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1ban h SER 92 CO 0.61 0.27 -0.07 -0.90 -0.87 0.00 0.00 176.83 175.87 1ban n ASP 93 N -4.48 0.22 -0.81 4.97 5.68 -1.26 -4.93 116.55 115.94 1ban n ASP 93 Ca 0.01 -0.30 -0.05 0.00 -0.50 0.00 0.00 54.79 53.96 1ban n ASP 93 Cb 0.08 -0.18 0.01 0.00 -1.14 0.00 0.00 41.12 39.88 1ban n ASP 93 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1ban n TRP 94 N -1.17 -0.40 -2.77 2.11 5.03 0.19 -5.05 117.44 115.39 1ban n TRP 94 Ca 0.14 0.09 -0.37 0.00 3.03 0.00 0.00 57.50 60.38 1ban n TRP 94 Cb 0.26 -1.78 -0.06 0.00 -1.03 0.00 0.00 31.31 28.70 1ban n TRP 94 CO 0.00 0.00 0.00 -0.51 -0.03 0.00 0.00 177.69 177.15 1ban s LEU 95 N -1.80 4.38 -0.05 -0.99 1.43 -1.26 -4.83 118.68 115.56 1ban s LEU 95 Ca 0.05 1.86 0.04 0.00 -1.03 0.00 0.00 54.13 55.06 1ban s LEU 95 Cb -0.02 -3.96 -0.00 0.00 0.03 0.00 0.00 46.19 42.23 1ban s LEU 95 CO 0.07 -0.05 -0.18 -0.63 0.23 0.00 0.00 176.35 175.79 1ban s ILE 96 N -1.55 1.53 0.39 -0.59 1.01 -0.03 -2.18 121.20 119.78 1ban s ILE 96 Ca 0.49 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.42 1ban s ILE 96 Cb -0.20 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 1ban s ILE 96 CO 0.25 0.44 0.07 -0.31 0.00 0.00 0.00 174.94 175.39 1ban s TYR 97 N 0.12 1.93 -0.03 3.97 1.51 -0.13 -2.07 117.35 122.64 1ban s TYR 97 Ca -0.06 -1.06 -0.13 0.00 -1.01 0.00 0.00 57.07 54.81 1ban s TYR 97 Cb -0.13 -1.33 0.02 0.00 -0.11 0.00 0.00 41.96 40.41 1ban s TYR 97 CO 0.03 -0.04 0.29 -1.59 -1.11 0.00 0.00 175.55 173.13 1ban s LYS 98 N -3.81 0.58 0.01 -0.62 0.00 -0.56 -0.96 119.74 114.38 1ban s LYS 98 Ca 0.27 -0.09 0.02 0.00 0.00 0.00 0.00 55.97 56.16 1ban s LYS 98 Cb 0.05 0.26 -0.01 0.00 0.00 0.00 0.00 37.83 38.13 1ban s LYS 98 CO 0.13 -0.14 -0.06 -0.08 0.00 0.00 0.00 175.35 175.20 1ban s THR 99 N -1.03 0.48 0.00 3.79 -1.32 0.24 -2.48 115.64 115.32 1ban s THR 99 Ca -0.11 -0.50 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 1ban s THR 99 Cb -0.05 -0.45 0.00 0.00 -1.51 0.00 0.00 72.50 70.49 1ban s THR 99 CO 0.03 -0.03 0.36 0.35 -2.21 0.00 0.00 174.62 173.12 1ban n THR 100 N 2.49 0.12 -1.56 5.08 -2.24 -1.26 -0.11 114.28 116.80 1ban n THR 100 Ca -0.16 -0.27 0.07 0.00 -2.27 0.00 0.00 64.05 61.42 1ban n THR 100 Cb 0.57 1.35 0.18 0.00 -2.10 0.00 0.00 70.33 70.33 1ban n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ban n ASP 101 N -0.06 1.76 -3.34 3.42 5.75 -1.23 -4.54 116.55 118.32 1ban n ASP 101 Ca 0.00 -3.61 -0.16 0.00 -0.01 0.00 0.00 54.79 51.00 1ban n ASP 101 Cb 0.22 -0.49 0.08 0.00 -1.03 0.00 0.00 41.12 39.91 1ban n ASP 101 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1ban n HIS 102 N -1.07 -2.16 -1.54 2.11 -0.00 -0.49 -3.12 115.22 108.95 1ban n HIS 102 Ca 0.17 0.90 -0.13 0.00 -0.00 0.00 0.00 57.72 58.66 1ban n HIS 102 Cb 0.71 -4.89 -0.05 0.00 -0.00 0.00 0.00 29.99 25.76 1ban n HIS 102 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1ban n TYR 103 N -3.93 -0.12 0.09 1.57 4.02 -1.26 -4.89 117.16 112.64 1ban n TYR 103 Ca -0.26 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.72 1ban n TYR 103 Cb 0.66 -2.49 -0.01 0.00 -0.02 0.00 0.00 39.34 37.48 1ban n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1ban h GLN 104 N 0.00 0.00 -3.66 -0.72 7.50 -1.95 -3.47 115.11 112.81 1ban h GLN 104 Ca -0.28 0.00 -0.20 0.00 0.50 0.00 0.00 58.65 58.67 1ban h GLN 104 Cb 0.93 0.00 -0.26 0.00 0.05 0.00 0.00 27.48 28.20 1ban h GLN 104 CO 0.39 0.09 -0.66 0.99 -1.50 0.00 0.00 178.83 178.15 1ban s THR 105 N -3.23 0.02 0.02 -0.54 2.01 -1.26 -5.10 115.64 107.56 1ban s THR 105 Ca -0.01 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.84 1ban s THR 105 Cb 0.09 -0.13 -0.02 0.00 0.01 0.00 0.00 72.50 72.45 1ban s THR 105 CO 0.79 -0.10 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.15 1ban s PHE 106 N -0.30 0.89 -0.09 4.92 0.40 -1.26 -4.30 117.98 118.25 1ban s PHE 106 Ca -0.03 -0.30 0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1ban s PHE 106 Cb -0.02 -0.54 0.02 0.00 0.51 0.00 0.00 43.02 42.98 1ban s PHE 106 CO 0.00 -0.01 -0.13 0.99 0.70 0.00 0.00 175.22 176.77 1ban s THR 107 N -0.70 1.30 0.29 0.64 2.01 -1.04 -4.97 115.64 113.17 1ban s THR 107 Ca -0.00 -0.53 -0.29 0.00 0.31 0.00 0.00 61.69 61.17 1ban s THR 107 Cb -0.06 -1.20 -0.10 0.00 0.01 0.00 0.00 72.50 71.15 1ban s THR 107 CO 0.00 0.40 1.16 -0.75 -0.69 0.00 0.00 174.62 174.74 1ban s LYS 108 N 0.96 4.56 0.00 4.92 2.20 -1.26 -1.50 119.74 129.62 1ban s LYS 108 Ca -0.08 1.92 0.00 0.00 -0.36 0.00 0.00 55.97 57.45 1ban s LYS 108 Cb -0.15 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.01 1ban s LYS 108 CO -0.00 0.10 0.02 0.44 -0.36 0.00 0.00 175.35 175.54 1ban n ILE 109 N 1.12 0.00 -1.81 5.43 -5.35 -0.88 -4.95 119.36 112.92 1ban n ILE 109 Ca -0.01 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 1ban n ILE 109 Cb 0.44 1.09 0.00 0.00 -1.74 0.00 0.00 39.64 39.43 1ban n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33